AG003NRM

1999-85-5 | ALPHA,ALPHA'-DIHYDROXY-1,3-DIISOPROPYLBENZENE

AG003NRM

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CAS Number	1999-85-5
Catalog Number	AG003NRM(AGN-PC-0QR0GK)
Chemical Name	ALPHA,ALPHA'-DIHYDROXY-1,3-DIISOPROPYLBENZENE
EC Number	217-886-1
IUPAC Name	2-[3-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
InChI	InChI=1S/C12H18O2/c1-11(2,13)9-6-5-7-10(8-9)12(3,4)14/h5-8,13-14H,1-4H3
InChI Key	UGPWRRVOLLMHSC-UHFFFAOYSA-N
MDL Number	MFCD00059139
Molecular Formula	C12H18O2
Molecular Weight	194.2701
SMILES	CC(C1=CC(C(C)(O)C)=CC=C1)(O)C
UNII	G9PAL4YV6C
Synonyms	1999-85-5, alpha,alpha'-Dihydroxy-1,3-diisopropylbenzene, 2,2'-(1,3-Phenylene)bis(propan-2-ol), UNII-G9PAL4YV6C, 2,2'-(1,3-phenylene)dipropan-2-ol, 2-[3-(2-hydroxypropan-2-yl)phenyl]propan-2-ol, G9PAL4YV6C, 1,3-Bis(alpha-hydroxyisopropyl)benzene, UGPWRRVOLLMHSC-UHFFFAOYSA-N, 1,3-Benzenedimethanol, .alpha.,.alpha.,.alpha.',.alpha.'-tetramethyl-, .alpha.,.alpha.'-Dihydroxy-m-diisopropylbenzene, alpha,alpha,alpha',alpha'-Tetramethyl-1,3-benzenedimethanol, Meta-diol, EINECS 217-886-1, 1,3-Benzenedimethanol, alpha,alpha,alpha',alpha'-tetramethyl-, AC1L2MPV, EC 217-886-1, AC1Q76VT, SCHEMBL304190, CTK4E2995, 1,3-bis(hydroxyisopropyl) benzene, ZINC395556, 1,3-Benzenedimethanol, alpha1,alpha1,alpha3,alpha3-tetramethyl-, 2,2'-(m-Phenylene)di-2-propanol, alpha,alpha,alpha',alpha'-Tetramethyl-m-xylene-alpha,alpha'-diol, KS-000017BH, MFCD00059139, 1,3-bis(2-hydroxy-2-propyl)benzene, AKOS015889109, MCULE-6361498069, NE11098, 2,2'-(1,3-Phenylene)di(2-propanol), 1,3-bis(1-hydroxy-1-methylethyl)benzene, ZB012533, alpha,alpha-Dihydroxy-1,3-diisopropylbenzene, D1788, FT-0744747, ST51038296, EN300-79886, 2-[3-(1-hydroxy-isopropyl)phenyl]propan-2-ol, 1,3-Benzenedimethanol,a1,a1,a3,a3-tetramethyl-, alpha,alpha&#39-Dihydroxy-1,3-diisopropylbenzene, W-109736, 1,3-Benzenedimethanol, |A1,|A1,|A3,|A3-tetramethyl-, Z1259339945, 1,3-Benzenedimethanol, .alpha.1,.alpha.1,.alpha.3,.alpha.3-tetramethyl-, InChI=1/C12H18O2/c1-11(2,13)9-6-5-7-10(8-9)12(3,4)14/h5-8,13-14H,1-4H, C12H18O2, CID74816, AR-1D0072, ACN-042002, C12-H18-O2, alpha,alpha/'-Dihydroxy-1,3-diisopropylbenzene, 2043-93-8,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.131g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.274g/mol
Monoisotopic Mass	194.131g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
UN Code

Certificate of Analysis

Lot Number